SCHEMBL14219385

SCHEMBL14219385

C/C=C/CCC1CCC(c2ccc(-c3cc(F)c(C[C@@H](C)c4ccccc4)c(F)c3)cc2)CC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
LPAR1 Q92633 1/20 0.32
LPAR3 Q9UBY5 1/20 0.32
APP P05067 1/20 0.31
FFAR1 O14842 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14219310 1.00 DGAT1 (0.33) DGAT1NPC1RAB9ALPAR1LPAR3
SCHEMBL14219317 0.88 MAOB (0.31)
SCHEMBL14219908 0.88 OPRM1 (0.30)
SCHEMBL14220016 0.87 CYP2C9 (0.39) DGAT1NPC1RAB9ALPAR1LPAR3
SCHEMBL14219423 0.84 DGAT1 (0.32) DGAT1NPC1RAB9ALPAR1LPAR3
SCHEMBL14219591 0.84
SCHEMBL14219929 0.82
SCHEMBL14219966 0.82
SCHEMBL14219313 0.81 APP (0.40) DGAT1NPC1RAB9AAPPFFAR1
SCHEMBL14219393 0.81 CYP2D6 (0.32)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1650285-B1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed